A variational approach to distribution function theory

We present a novel formalism for the generation of integral equations for the distribution functions of fluids. It is based on a cumulant expansion for the free energy. Truncation of the expansion at theKth term and minimization of the resulting approximation leads to equations for the distribution functions up toKth order.The formalism is not limited to systems with two-body interactions and does not require the addition of closure relations to yield a complete set of equations. In fact, it automatically generates superposition approximations, such as the Kirkwood three-body superposition approximation or the Fisher-Kopeliovich four-body one.The conceptual approach is adapted from the cluster variation method of lattice theory.     

Cluster expansion in the truncated bootstrap model and linear graphs theory

Using the formalism of linear graphs theory, we obtain the cluster expansion for the grand potential of interacting hadronic systems in the framework of the truncated bootstrap model. We show that the coefficients of the expansion are constructed from two classes of Cayley-tree graphs contributing with opposite sign, related to the two-phase nature of the truncated bootstrap model.     

Theory of irreversible processes in nonequilibrium quantum systems. II. Cluster expansions with contraction for homogenous systems

On the basis of a method developed in a previous paper, a systematic rule for obtaining a symmetrized collision superoperator of the Van Hove generalized master equation including an arbitrary number of particles is given. In the formalism, the quantum statistical effect is taken into account through the use of contractions (internal and external contractions) on the basis of the cluster expansion. As an application of this general rule, a symmetrized collision superoperator including the effect of three-particle collisions is obtained.     

Medium-dependent dynamics in Fermi systems from a pair-composite viewpoint

We examine the effects of medium dependence of the two-body dynamics on the many-body properties of Fermion systems, with approximation ultimately aimed at lower densities for all temperatures. The dynamics are initially treated in terms of a pair-composite formulation given previously, and the underlying single-Fermion nature of the pair constituents allows interpretation via more conventional thermal many-body formalism. This permits construction of coupled equations for composite amplitudes and bound states, single-particle energy and momentum distributions, and macroscopic thermodynamic properties. We explore differences between our results and those of traditional theories which incorporate two-body correlations in some fashion, and we display explicitly how correct limiting results are recovered from our equations when the density and/or coupling strength is decreased. Finally, we provide an interpretation of our results via a form of quasiparticle quantum cluster expansion analogous to the familiar particle quantum cluster expansion.     

Diagrammatic analysis of correlations in polymer fluids: Cluster diagrams via Edwards’ field theory

Edwards’ functional integral approach to the statistical mechanics of polymer liquids is amenable to a diagrammatic analysis in which free energies and correlation functions are expanded as infinite sums of Feynman diagrams. This analysis is shown to lead naturally to a perturbative cluster expansion that is closely related to the Mayer cluster expansion developed for molecular liquids by Chandler and co-workers. Expansion of the functional integral representation of the grand-canonical partition function yields a perturbation theory in which all quantities of interest are expressed as functionals of a monomer-monomer pair potential, as functionals of intramolecular correlation functions of non-interacting molecules, and as functions of molecular activities. In different variants of the theory, the pair potential may be either a bare or a screened potential. A series of topological reductions yields a renormalized diagrammatic expansion in which collective correlation functions are instead expressed diagrammatically as functionals of the true single-molecule correlation functions in the interacting fluid, and as functions of molecular number density. Similar renormalized expansions are also obtained for a collective Ornstein-Zernicke direct correlation function, and for intramolecular correlation functions. A concise discussion is given of the corresponding Mayer cluster expansion, and of the relationship between the Mayer and perturbative cluster expansions for liquids of flexible molecules. The application of the perturbative cluster expansion to coarse-grained models of dense multi-component polymer liquids is discussed, and a justification is given for the use of a loop expansion. As an example, the formalism is used to derive a new expression for the wave-number dependent direct correlation function and recover known expressions for the intramolecular two-point correlation function to first-order in a renormalized loop expansion for coarse-grained models of binary homopolymer blends and diblock copolymer melts.     

Linear quantum Enskog equation. I. Homogeneous quantum fluids

The quantum-statistical generalization of the well-known classical, linear revised Enskog equation is derived for spatially uniform systems. This new quantum kinetic equation allows the study of equilibrium time correlation functions and their associated transport coefficients of normal quantum fluids where static correlations and degeneracy effects due to particle statistics (both are treated exactly) are important. Furthermore, we derive the quantum-statistical analog of the classical ring operator. These microscopic and systematic derivations are based on a recently developed superoperator formalism (including cluster expansion techniques) that, as a main feature, allows a clear distinction between static and dynamic correlations, which is crucial in the discussion of the Enskog approximation.     

Multiple scattering with three-body forces

The multiple-scattering formalism is generalized to account for simultaneous interactions of a projectile with two target particles. In the cluster expansion of multiple-scattering theory such three-body interactions combine with iterates of two-body interactions. Some comparisons of multiple scattering with the Faddeev theory are given.     

Orientational Order Parameters for Arbitrary Quantum Systems

The concept of quantum-mechanical nematic order, which is important in systems such as superconductors, is based on an analogy to classical liquid crystals, where order parameters are obtained through orientational expansions. This method is generalized to quantum mechanics based on an expansion of Wigner functions. This provides a unified framework applicable to arbitrary quantum systems. The formalism recovers the standard definitions for spin systems. For Fermi liquids, the formalism reveals the nonequivalence of various definitions of the order parameter used in the literature. Moreover, new order parameters for quantum molecular systems with low symmetry are derived, which cannot be properly described with the usual nematic tensors.     

序参量-统计格林函数耦合方程组

本文建议一个自洽求解量子统计系统中序参量和费密型元激发及序参量集体激发的能谱、耗散和准粒子分布的联立方程组,并给出系统的圈图展开方法。这一理论方法既适用于平衡态,也适用于非平衡态。 关键词：     

Multipole expansion of non-local coupling potentials for cluster transfer and application to 16O(16O, 12C)20Ne

When the transfer of clusters and the symmetrization (antisymmetrization) of scattering wave functions is described by cluster models within the coupled-channel formalism, non-local coupling potentials arise. We suggest a procedure to calculate these potentials by a multipole expansion of all potentials and wave functions which depend on sums of vectors. The expansion coefficients are found by least-squares fit. The method is applied to the ¹⁶O(¹⁶O, ¹²C)²⁰Ne reaction, which is treated in the cluster model with two inert ¹²C- and α-clusters as constituents.     

Five- and six-body resonances tied to an Efimov trimer

We explore the properties of weakly bound bosonic states in the strongly interacting regime. Combining a correlated-Gaussian basis set expansion with a complex-scaling method, we extract the energies and structural properties of bosonic cluster states with N ≤ 6 for different two-body potentials. The identification of five- and six-body resonances attached to the first-excited-Efimov trimer provides strong support to the premise of Efimov universality in bosonic systems. Our study also reveals a rich structure of bosonic cluster states. Besides the lowest cluster states that behave as bosonic droplets, we identify cluster states weakly bound to one or two atoms forming effective cluster-atom dimers and cluster-atom-atom "trimers." The experimental signatures of these cluster states are discussed.     

Spatially inhomogeneous thermo field dynamics

Non-equilibrium thermo field dynamics is extended to treat spatially inhomogeneous systems. A canonical formalism of thermally dissipative semi-free fields describing spatially inhomogeneous situations is presented. With this formalism, a scheme of perturbative calculations is developed and the “on-shell” renormalization condition is discussed. We illustrate this scheme using a model of particles interacting with impurities and find that the self-consistent renormalization condition gives the kinetic equation for the averaged particle number density as well as the renormalized energy and the dissipative coefficient. It is also shown that this kinetic equation can be reduced to the Boltzmann equation in the gradient expansion approximation.     

A phase cell cluster expansion for a hierarchical Ø 3 4 model

The formalism developed in a previous paper is applied to yield a phase cell cluster expansion for a hierarchical ø ₃ ⁴ model. The field is expanded into modes with specific renormalization group scaling properties. The present cluster expansion for a vacuum expectation value is formally the natural factorization of each term in the perturbation expansion into the contribution of modes connected to the variables in the expectation via interactions, and that of the complementary set. The expectation value is thus realized as a sum of contributions due tofinite subsets of the modes. We emphasize the following additional features:

1. Partitions of unity are not used.
2. There areessentially no cut-offs.
3. The expansion is developed directly, without an initial need to prove an ultraviolet stability bound, the most difficult part of the traditional approach.

Our main interest in the present phase cell cluster expansion is founded in the belief that it may be the right vehicle for proving the existence of a nontrivial four-dimensional field theory.     

Multiple-reflection effects in hadron-nucleus scattering: (I). Cluster expansion of the optical potential

A basic assumption underlying the high-energy hadron-nucleus optical potential is that no target nucleon is struck more than once. Although this condition is satisfied at high energy, such is not the case in the vicinity of medium-energy resonances, where the amplitude for the projectile to undergo multiple reflections between two target nucleons is quite large. As a remedy for this problem, the multiple-scattering series is rearranged such that the optical potential can be expressed as a cluster expansion. The lowest order optical potential is modified by a two-body cluster term, which is a sum of all possible reflections of the projectile between a pair of target nucleons. This term is evaluated for a model potential within the formalism of Foldy and Walecka: it is substantially smaller than the contribution of a single reflection, and its overall effect is small under certain additional restrictions. If the independent-pair picture of nuclei is valid, then the three-body cluster term may be small, and the lowest order Glauber optical potential can provide a self-consistent picture of hadron-nucleus interactions, even though a term-by-term expansion of the multiple-scattering series does not provide such assurance.     

An extension of the coupled cluster formalism to excited states (I)

The expS method (coupled cluster formalism) is extended to excited states of finite and infinite systems. We obtain equations which are formally similar to the known ground-state equations of the expS theory. The method is applicable to Fermi as well as Bose systems.     

The cluster expansion for classical and quantum lattice systems

We develop a high-temperature expansion for general lattice systems which can be applied to classical as well as quantum systems. Applying the expansion we prove analyticity of correlation functions, uniqueness of equilibrium states, and cluster properties for classical and quantum lattice systems in the high-temperature region.     

Jastrow-type calculations for nuclear matter with the normalization condition

Results are given of constrained Jastrow calculations for the energy per particle and the density of nuclear matter using the test potentials IY and OMY-6, as well as several others, and various correlation functions involving parameters. The constraint chiefly employed is the normalization condition in first order, a condition naturally entering the Jastrow formalism. The energy in the minimization is approximated by the first two and in some cases by the first three terms of its FIY cluster expansion. In addition to the three-body terms in the FIY expansion, the corresponding terms of the AHT expansion are also calculated for comparison. From the computations which were performed it seems that, at least in some cases, the normalization condition constitutes a quite satisfactory constraint, leading to reliable results, when used in low order calculations. In addition, conclusions are drawn as to the sensitivity of the results to the constraint, correlation function and minimized energy expression.     

An essentially exact many body calculation for muonic molecular ions and exotic coulombic systems

The L = 0 bound states and the structural properties of muonic molecular ions and exotic nuclear molecular ions are calculated by a hyperspherical harmonics expansion method, which is an essentially exact method for three-body systems. We examine the convergence rate of this method and also examine its crucial dependence on the mass ratio ? (ratio of the masses of similar to dissimilar particles). An a priori criterion for the rate of convergence and the required size of the expansion basis for a predetermined precision have been suggested. Our calculation reveals the cluster type of structure of these systems.     

A monte carlo method for approximating critical cluster size in the nucleation of model systems

A formalism is presented for estimating critical cluster size as defined in classical models for nucleation phenomena. The method combines Bennett's Monte Carlo technique for determining free-energy differences for clusters containingn andn- 1 atoms with the steady state nucleation rate formalism. A simple form for the free energy of formation of then cluster [including a termA (n)n ^2/3] is used to predict critical cluster size and critical supersaturation ratio, S^*. This approach is applied to Lennard-Jones vapor clusters at 60 K. Results for free-energy differences for the 13, 18, 24, and 43 clusters predict a critical cluster size of 70 ± 5 atoms at a critical supersaturation ratio given bylnS ^*=2,45 0.15. This method is intended to provide estimates of critical cluster size for more ambitious attempts to calculate cluster free energies or for initializing conditions in microscopic simulations of nucleating systems.This material is based upon work supported by the National Science Foundation under Grant No. ATM80 15790 and the National Aeronautics and Space Administration under Grant No. NAS8-31150.     

二维费密液体理论(Ⅱ)——3He朗道参数的计算

本文采用相关基波函数(CBF)方法研究了二维³He液体的性质。基于集团展开利用配分函数的变分原理,将这一方法推广到有限温度情形。从Lennard-Jones势出发,在二级微扰近似下数值计算了二维³He液体的基态能、准粒子谱和朗道参数。 关键词：